[(Z)-thiolan-3-ylideneamino] N-phenylcarbamate
Formula:C11H12N2O2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-thiolan-3-ylideneamino] N-phenylcarbamate is a drug-like molecule.
| MolName | [(Z)-thiolan-3-ylideneamino] N-phenylcarbamate |
| MolecularFormula | C11H12N2O2S |
| Smiles | O=C(Nc1ccccc1)O/N=C1\CSCC1 |
| InChI | InChI=1S/C11H12N2O2S/c14-11(12-9-4-2-1-3-5-9)15-13-10-6-7-16-8-10/h1-5H,6-8H2,(H,12,14) |
| InChIK | FZLYKJFLNTTYJV-UHFFFAOYSA-N |
| TotalMolweight | 236.294 |
| Molweight | 236.294 |
| MonoisotopicMass | 236.061948 |
| CLogP | 2.5636 |
| CLogS | -3.676 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 180.71 |
| Relative PSA | 0.35139 |
| PolarSurfaceArea | 75.99 |
| Druglikeness | -5.1259 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6875 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 5 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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